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2-(diethylcarbamoyl)-8,8-diphenyl-oct-7-enoic acid ethyl ester
SpectraBase Compound ID Ezv64X5tNgT
InChI InChI=1S/C27H35NO3/c1-4-28(5-2)26(29)25(27(30)31-6-3)21-15-9-14-20-24(22-16-10-7-11-17-22)23-18-12-8-13-19-23/h7-8,10-13,16-20,25H,4-6,9,14-15,21H2,1-3H3
InChIKey CCRUQRUHXOHIFJ-UHFFFAOYSA-N
Mol Weight 421.6 g/mol
Molecular Formula C27H35NO3
Exact Mass 421.261694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EeDZ30tAZX3
Name 2-(diethylcarbamoyl)-8,8-diphenyl-oct-7-enoic acid ethyl ester
Alternate Name(s) 2-[diethylamino(oxo)methyl]-8,8-diphenyl-7-octenoic acid ethyl ester Ethyl 2-(diethylcarbamoyl)-8,8-diphenyl-oct-7-enoate
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Formula C27H35NO3
InChI InChI=1S/C27H35NO3/c1-4-28(5-2)26(29)25(27(30)31-6-3)21-15-9-14-20-24(22-16-10-7-11-17-22)23-18-12-8-13-19-23/h7-8,10-13,16-20,25H,4-6,9,14-15,21H2,1-3H3
InChIKey CCRUQRUHXOHIFJ-UHFFFAOYSA-N
Molecular Weight 421.581 g/mol
SMILES C(C(C(=O)OCC)CCCCC=C(c1ccccc1)c1ccccc1)(N(CC)CC)=O
SPLASH splash10-00di-6900500000-956e66e5148df6aa4c75
Source of Spectrum J-63-791-8
Wiley ID 1378367